Information card for entry 4301307

Structure parameters

• Formula: C18 H23 Cu2 I2 N S2
• Calculated formula: C18 H23 Cu2 I2 N S2
• Title of publication: Structures of Copper Complexes of the Hybrid [SNS] Ligand of Bis(2-(benzylthio)ethyl)amine and Facile Catalytic Formation of 1-Benzyl-4-phenyl-1H-1,2,3-triazole through Click Reaction
• Authors of publication: Shi-Qiang Bai; Lip Lin Koh; T. S. Andy Hor
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 1207 - 1213
• a: 9.1552 ± 0.0006 Å
• b: 10.7244 ± 0.0007 Å
• c: 12.2586 ± 0.0008 Å
• α: 93.343 ± 0.001°
• β: 100.822 ± 0.001°
• γ: 105.48 ± 0.001°
• Cell volume: 1131.81 ± 0.13 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0573
• Residual factor for significantly intense reflections: 0.0478
• Weighted residual factors for significantly intense reflections: 0.1134
• Weighted residual factors for all reflections included in the refinement: 0.1182
• Goodness-of-fit parameter for all reflections included in the refinement: 1.099
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No